N-(furan-2-ylmethyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-carbothioamide Openeye Name: N-(2-furylmethyl)-4-(1-naphthylmethyl)piperazin-4-ium-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-(1-naphthalenylmethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-carbothioamide Traditional Name: N-(2-furfuryl)-4-(1-naphthylmethyl)piperazin-4-ium-1-carbothioamide Formula: C21H24N3OS+ MolecularWeight: 366.49976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=S)NCC4=CC=CO4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C21H23N3OS/c26-21(22-15-19-8-4-14-25-19)24-12-10-23(11-13-24)16-18-7-3-6-17-5-1-2-9-20(17)18/h1-9,14H,10-13,15-16H2,(H,22,26)/p+1